Compound Identification
SMILES
[2H]N([2H])[C@@]1([2H])C([2H])([2H])N(C2=C([2H])C(=O)N(C(=O)N2C([2H])([2H])C2=C([2H])C([2H])=C([2H])C([2H])=C2C#N)C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])C1([2H])[2H]
InChIKey
InChIKey=ZSBOMTDTBDDKMP-TZLXAXSWSA-N
Formula
C18H21N5O2
Mass
360.527
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Dialkylarylamines Pyrimidones Aminopyrimidines and derivatives Piperidines Vinylogous amides Heteroaromatic compounds Ureas Lactams Nitriles Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Dialkylarylamine - Aminopyrimidine - Pyrimidone - Piperidine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Lactam - Urea - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Cyanide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors
Not available